Vitas-M small molecule compound
9-bromo-5-(2-chloro-5-fluorophenyl)-2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL191939
SMILES Brc1ccc2c(c1)C1CC(=NN1C(O2)c1cc(F)ccc1Cl)c1cccs1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H13BrClFN2OS MW 463.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrClFN2OS/c21-11-3-6-18-14(8-11)17-10-16(19-2-1-7-27-19)24-25(17)20(26-18)13-9-12(23)4-5-15(13)22/h1-9,17,20H,10H2InChIKey
HCMGQUAVSAPMRW-UHFFFAOYSA-NSynonyms
9bromo5(2chloro5fluorophenyl)2(thiophen2yl)110bdihydropyrazolo(15c)(13)benzoxazine
9bromo5(2chloro5fluorophenyl)2thiophen2yl510bdihydro1Hpyrazolo(15c)(13)benzoxazine
C1C2C3=C(C=CC(=C3)Br)OC(N2N=C1C4=CC=CS4)C5=C(C=CC(=C5)F)Cl
InChI=1SC20H13BrClFN2OSc2111361814(811)171016(192172719)2425(17)20(2618)13912(23)4515(13)22h191720H10H2
MFCD22390452
ZINC000072332635
ZINC000106937339
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